BBWL48 -OEChem-04022109402D 38 40 0 0 0 0 0 0 0999 V2000 2.0000 0.2347 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -2.4974 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 1.8148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.5701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -0.7653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 -1.6314 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 0.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 0.9899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -0.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 2.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5013 0.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 2.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4798 0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7905 1.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 -1.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0796 2.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8344 1.6096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2411 1.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 -2.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4379 -0.2284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7301 2.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3087 -0.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3152 2.9422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8939 0.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9379 -2.1683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9379 -1.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 2.5727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2723 3.3546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4903 2.9579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 23 2 0 0 0 0 3 16 2 0 0 0 0 4 22 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 14 1 0 0 0 0 6 27 1 0 0 0 0 7 14 1 0 0 0 0 7 23 1 0 0 0 0 7 28 1 0 0 0 0 8 13 2 0 0 0 0 8 19 1 0 0 0 0 9 16 1 0 0 0 0 9 19 1 0 0 0 0 9 31 1 0 0 0 0 10 23 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 17 20 1 0 0 0 0 17 29 1 0 0 0 0 18 21 2 0 0 0 0 18 30 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$